methyl 3-[1-(3,4-dichlorophenyl)ethyl]-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-[1-(3,4-dichlorophenyl)ethyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-[1-(3,4-dichlorophenyl)ethyl]-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-[1-(3,4-dichlorophenyl)ethyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[1-(3,4-dichlorophenyl)ethyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-[1-(3,4-dichlorophenyl)ethyl]-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C13H12Cl2N2O2S MolecularWeight: 331.21758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)N2C(=CNC2=S)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)Cl)Cl)N2C(=CNC2=S)C(=O)OC

InChI

InChI=1S/C13H12Cl2N2O2S/c1-7(8-3-4-9(14)10(15)5-8)17-11(12(18)19-2)6-16-13(17)20/h3-7H,1-2H3,(H,16,20)